5-chloranyl-N-[5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]pentanamide

Systemtic Name: 5-chloranyl-N-[5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]pentanamide Openeye Name: N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-5-chloro-pentanamide CAS Name: 5-chloro-N-[5-(phenylmethylthio)-1,3,4-thiadiazol-2-yl]pentanamide IUPAC Name: N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-5-chloropentanamide Traditional Name: N-[5-(benzylthio)-1,3,4-thiadiazol-2-yl]-5-chloro-valeramide Formula: C14H16ClN3OS2 MolecularWeight: 341.87934

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=NN=C(S2)NC(=O)CCCCCl

Isomeric SMILES

C1=CC=C(C=C1)CSC2=NN=C(S2)NC(=O)CCCCCl

InChI

InChI=1S/C14H16ClN3OS2/c15-9-5-4-8-12(19)16-13-17-18-14(21-13)20-10-11-6-2-1-3-7-11/h1-3,6-7H,4-5,8-10H2,(H,16,17,19)